Vitas-M small molecule compound
(2Z)-2-(7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-5(6H)-ylidene)-N-(3-methoxypropyl)ethanethioamide
Catalog ID
STK572195
SMILES COCCCNC(=S)/C=C/1\NCCc2c1cc1OCOc1c2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H20N2O3S MW 320.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O3S/c1-19-6-2-4-18-16(22)9-13-12-8-15-14(20-10-21-15)7-11(12)3-5-17-13/h7-9,17H,2-6,10H2,1H3,(H,18,22)/b13-9-InChIKey
PQZBEMBPFVVDNX-LCYFTJDESA-NSynonyms
898920-21-3(2Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)N(3methoxypropyl)ethanethioamide
(2Z)2(78dihydro6H(13)dioxolo(45g)isoquinolin5ylidene)N(3methoxypropyl)ethanethioamide
(Z)2(78dihydro(13)dioxolo(45g)isoquinolin5(6H)ylidene)N(3methoxypropyl)ethanethioamide
898920213
COCCCNC(=S)C=C1C2=CC3=C(C=C2CCN1)OCO3
COCCCNC(=S)C=C1NCCc2c1cc1OCOc1c2
InChI=1SC16H20N2O3Sc1196241816(22)9131281514(20102115)711(12)351713h7917H2610H21H3(H1822)b139
MFCD07639022
ZINC000101373607
ZINC101373607
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